==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 19-JAN-09 2W8R . COMPND 2 MOLECULE: SUCCINATE-SEMIALDEHYDE DEHYDROGENASE, . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.-G.KIM,K.-J.KIM . 485 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20281.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 345 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 36 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 1 0 1 1 2 3 0 1 0 1 2 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 3 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 51 A L 0 0 165 0, 0.0 3,-0.1 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0-114.6 23.7 -27.2 -49.7 2 52 A A + 0 0 72 1,-0.2 35,-0.0 2,-0.1 3,-0.0 0.347 360.0 97.3 -71.6-152.9 23.4 -28.4 -46.1 3 53 A G + 0 0 79 1,-0.0 -1,-0.2 3,-0.0 3,-0.1 0.443 59.2 128.7 83.1 -0.6 20.3 -28.1 -43.9 4 54 A L S S- 0 0 40 -3,-0.1 2,-0.5 1,-0.1 3,-0.1 0.571 73.3 -69.8 -59.8-142.5 19.1 -31.6 -44.7 5 55 A S >> - 0 0 46 1,-0.1 3,-2.7 82,-0.0 4,-1.2 -0.940 35.2-138.1-125.3 105.2 18.2 -34.2 -42.0 6 56 A A T 34 S+ 0 0 98 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.1 0.724 103.8 54.6 -28.6 -41.5 21.2 -35.4 -40.0 7 57 A A T 34 S+ 0 0 29 1,-0.2 -1,-0.3 -3,-0.1 185,-0.1 0.836 105.4 50.9 -68.7 -36.0 19.8 -38.9 -40.2 8 58 A L T <4 S+ 0 0 1 -3,-2.7 2,-0.8 1,-0.1 -2,-0.2 0.847 98.9 67.8 -72.6 -37.1 19.5 -39.0 -44.0 9 59 A L S < S+ 0 0 70 -4,-1.2 2,-0.3 180,-0.1 -1,-0.1 -0.781 73.8 177.2 -89.3 110.8 23.0 -37.9 -44.7 10 60 A R - 0 0 60 -2,-0.8 178,-0.1 175,-0.2 179,-0.1 -0.867 31.8-177.7-120.1 152.1 25.3 -40.8 -43.6 11 61 A T + 0 0 57 -2,-0.3 30,-3.0 29,-0.1 2,-0.2 0.561 64.0 79.7-118.0 -16.9 29.0 -41.5 -43.7 12 62 A D S S- 0 0 50 28,-0.2 2,-0.1 9,-0.1 -2,-0.0 -0.571 82.3-107.6 -93.7 158.4 29.2 -44.9 -42.1 13 63 A S E -A 20 0A 2 7,-2.2 7,-2.7 -2,-0.2 2,-0.6 -0.382 29.2-129.5 -76.0 161.6 28.6 -48.2 -43.8 14 64 A F E +AB 19 206A 12 192,-2.1 192,-2.6 5,-0.2 2,-0.4 -0.942 38.7 156.3-119.6 109.5 25.4 -50.1 -42.8 15 65 A V E > -A 18 0A 15 3,-2.5 3,-1.2 -2,-0.6 190,-0.1 -0.998 66.2 -6.3-137.1 132.6 25.8 -53.7 -41.9 16 66 A G T 3 S- 0 0 25 -2,-0.4 185,-0.2 1,-0.3 3,-0.1 0.767 128.2 -54.9 58.6 29.8 23.6 -55.9 -39.7 17 67 A G T 3 S+ 0 0 30 187,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.701 118.1 104.2 78.1 19.8 21.3 -53.0 -38.8 18 68 A R E < S-A 15 0A 176 -3,-1.2 -3,-2.5 2,-0.0 2,-0.7 -0.986 72.6-122.3-137.1 146.3 24.3 -50.9 -37.5 19 69 A W E -A 14 0A 54 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.771 38.3-178.8 -86.7 115.7 26.3 -48.0 -38.8 20 70 A L E -A 13 0A 81 -7,-2.7 -7,-2.2 -2,-0.7 2,-0.1 -0.967 17.7-146.2-124.4 127.4 29.9 -49.0 -38.9 21 71 A P - 0 0 86 0, 0.0 2,-0.2 0, 0.0 -9,-0.1 -0.491 18.2-133.8 -83.9 157.6 32.9 -47.0 -40.0 22 72 A A - 0 0 18 2,-0.4 21,-0.1 -2,-0.1 19,-0.0 -0.491 28.5-100.6-102.3 176.8 35.9 -48.6 -41.8 23 73 A A S S+ 0 0 110 19,-0.2 2,-0.2 -2,-0.2 20,-0.1 0.886 107.9 29.2 -64.9 -37.4 39.6 -48.2 -41.1 24 74 A A S S- 0 0 50 18,-0.4 18,-2.2 2,-0.0 -2,-0.4 -0.662 71.2-154.2-116.7 172.0 39.8 -45.7 -44.0 25 75 A T E -H 41 0B 72 16,-0.3 16,-0.2 -2,-0.2 14,-0.1 -0.963 5.8-143.3-143.9 158.5 37.5 -43.2 -45.7 26 76 A F E -H 40 0B 11 14,-2.6 14,-2.6 -2,-0.3 2,-0.2 -0.931 23.3-113.7-125.0 150.3 37.1 -41.6 -49.1 27 77 A P E -H 39 0B 72 0, 0.0 2,-0.5 0, 0.0 12,-0.2 -0.578 19.9-161.1 -84.3 146.2 36.0 -38.1 -50.0 28 78 A V E -H 38 0B 6 10,-1.6 9,-3.3 -2,-0.2 10,-1.3 -0.996 13.8-172.2-127.0 122.9 32.8 -37.3 -51.9 29 79 A Q E -H 36 0B 115 -2,-0.5 7,-0.2 7,-0.2 6,-0.1 -0.908 34.4-101.9-120.9 147.0 32.6 -33.9 -53.5 30 80 A D > - 0 0 11 5,-2.5 4,-2.0 -2,-0.3 65,-0.2 -0.460 31.3-143.7 -61.2 119.0 29.8 -32.0 -55.3 31 81 A P T 4 S+ 0 0 14 0, 0.0 337,-0.4 0, 0.0 -1,-0.2 0.674 94.1 45.0 -63.6 -14.6 30.6 -32.5 -59.0 32 82 A A T 4 S+ 0 0 7 62,-0.2 336,-0.2 300,-0.1 337,-0.1 0.931 127.3 19.6 -91.9 -61.4 29.4 -29.0 -59.8 33 83 A S T 4 S- 0 0 54 2,-0.1 334,-0.0 334,-0.1 289,-0.0 0.658 93.6-128.5 -84.8 -20.2 30.9 -26.6 -57.1 34 84 A G < + 0 0 34 -4,-2.0 3,-0.1 1,-0.2 -1,-0.0 0.397 53.9 154.0 86.5 -3.6 33.7 -29.0 -56.0 35 85 A A - 0 0 47 1,-0.1 -5,-2.5 -6,-0.1 2,-0.4 -0.189 52.8-103.1 -59.0 145.7 32.6 -28.6 -52.4 36 86 A A E -H 29 0B 91 -7,-0.2 -7,-0.2 1,-0.2 -1,-0.1 -0.580 35.0-178.0 -73.6 125.7 33.4 -31.4 -49.9 37 87 A L E - 0 0 53 -9,-3.3 2,-0.3 -2,-0.4 -8,-0.2 0.840 53.4 -64.5 -91.7 -40.2 30.3 -33.4 -49.1 38 88 A G E -H 28 0B 21 -10,-1.3 -10,-1.6 2,-0.0 2,-0.7 -0.944 41.9 -85.4 168.0 170.8 31.7 -35.8 -46.6 39 89 A M E -H 27 0B 95 -2,-0.3 2,-0.4 -12,-0.2 3,-0.0 -0.902 44.0-163.1-104.8 112.7 34.0 -38.5 -45.6 40 90 A V E -H 26 0B 0 -14,-2.6 -14,-2.6 -2,-0.7 -28,-0.2 -0.764 28.1 -98.3-100.8 140.8 32.5 -41.9 -46.3 41 91 A A E -H 25 0B 1 -30,-3.0 2,-0.6 -2,-0.4 -16,-0.3 -0.195 29.6-146.9 -51.5 139.9 33.6 -45.3 -44.9 42 92 A D - 0 0 16 -18,-2.2 -18,-0.4 167,-0.1 167,-0.3 -0.747 19.5-155.6-115.0 82.6 35.8 -47.1 -47.4 43 93 A C - 0 0 0 165,-2.7 2,-0.2 -2,-0.6 174,-0.2 -0.170 7.9-160.6 -59.8 146.2 35.0 -50.8 -46.8 44 94 A G > - 0 0 14 172,-0.1 4,-2.2 165,-0.1 3,-0.5 -0.626 43.3 -74.4-119.1 179.8 37.5 -53.5 -47.6 45 95 A V H > S+ 0 0 45 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.785 129.6 53.9 -44.9 -34.5 37.4 -57.3 -48.2 46 96 A R H > S+ 0 0 175 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.952 108.0 46.6 -69.2 -49.0 36.9 -57.8 -44.5 47 97 A E H > S+ 0 0 63 -3,-0.5 4,-2.1 1,-0.2 -2,-0.2 0.863 113.7 52.3 -59.6 -35.7 34.0 -55.5 -44.1 48 98 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.964 107.5 47.5 -65.8 -54.8 32.5 -57.1 -47.2 49 99 A R H X S+ 0 0 100 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.892 113.3 51.9 -54.1 -38.8 32.8 -60.7 -46.0 50 100 A A H X S+ 0 0 36 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.909 108.8 49.2 -64.5 -42.1 31.3 -59.5 -42.7 51 101 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.877 109.0 53.3 -65.6 -37.9 28.4 -57.9 -44.5 52 102 A V H X S+ 0 0 0 -4,-2.8 4,-3.4 2,-0.2 3,-0.3 0.969 108.9 48.1 -61.0 -52.6 27.8 -61.1 -46.5 53 103 A R H X S+ 0 0 117 -4,-2.4 4,-2.5 1,-0.3 5,-0.3 0.902 109.8 53.8 -53.7 -42.7 27.6 -63.2 -43.3 54 104 A A H X S+ 0 0 24 -4,-2.2 4,-1.7 1,-0.2 -1,-0.3 0.891 113.2 43.0 -59.7 -38.9 25.2 -60.6 -41.9 55 105 A A H X S+ 0 0 0 -4,-2.0 4,-3.0 -3,-0.3 -2,-0.2 0.918 111.4 53.1 -73.6 -44.6 23.0 -61.0 -45.0 56 106 A Y H X S+ 0 0 104 -4,-3.4 4,-1.4 1,-0.2 -2,-0.2 0.879 112.9 44.7 -58.7 -39.9 23.3 -64.8 -45.1 57 107 A E H X S+ 0 0 108 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.878 112.6 50.4 -73.3 -36.6 22.1 -65.0 -41.5 58 108 A A H >X S+ 0 0 8 -4,-1.7 4,-3.4 -5,-0.3 3,-1.2 0.906 105.5 59.7 -66.0 -39.6 19.3 -62.5 -42.0 59 109 A F H 3X S+ 0 0 11 -4,-3.0 4,-3.0 1,-0.3 5,-0.3 0.917 95.8 59.1 -53.0 -51.1 18.2 -64.5 -45.0 60 110 A C H 3< S+ 0 0 47 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.752 118.3 33.0 -53.7 -24.4 17.6 -67.7 -43.0 61 111 A R H XX S+ 0 0 178 -3,-1.2 3,-1.0 -4,-0.6 4,-0.7 0.826 116.5 54.4 -97.4 -42.1 15.1 -65.7 -40.9 62 112 A W H >< S+ 0 0 3 -4,-3.4 3,-0.9 1,-0.3 -2,-0.2 0.860 100.3 59.6 -60.1 -41.2 13.8 -63.3 -43.6 63 113 A R T 3< S+ 0 0 119 -4,-3.0 -1,-0.3 1,-0.3 -3,-0.1 0.736 103.5 56.1 -61.0 -21.7 12.8 -66.1 -46.0 64 114 A E T <4 S+ 0 0 142 -3,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.734 83.6 101.4 -82.6 -26.8 10.5 -67.3 -43.1 65 115 A V S << S- 0 0 38 -3,-0.9 5,-0.1 -4,-0.7 -3,-0.0 -0.334 85.0-101.6 -61.8 138.9 8.6 -64.0 -42.9 66 116 A S > - 0 0 70 1,-0.1 4,-2.5 3,-0.1 5,-0.2 -0.203 21.9-123.4 -60.7 154.0 5.2 -64.1 -44.5 67 117 A A H > S+ 0 0 30 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.883 114.5 56.1 -65.6 -38.8 4.9 -62.4 -47.9 68 118 A K H > S+ 0 0 124 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.823 110.3 47.3 -63.3 -28.1 2.1 -60.2 -46.6 69 119 A E H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.909 111.5 47.2 -78.7 -45.4 4.6 -59.1 -43.9 70 120 A R H X S+ 0 0 23 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.864 111.8 53.7 -64.3 -32.5 7.5 -58.5 -46.3 71 121 A S H X S+ 0 0 14 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.928 106.9 50.8 -65.8 -43.7 5.1 -56.6 -48.5 72 122 A S H X S+ 0 0 42 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.874 110.4 48.6 -61.7 -40.7 4.1 -54.4 -45.6 73 123 A L H X S+ 0 0 8 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.887 109.9 51.7 -67.9 -39.9 7.7 -53.6 -44.8 74 124 A L H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.897 111.6 48.2 -64.7 -36.4 8.5 -52.7 -48.4 75 125 A R H X S+ 0 0 76 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.870 108.9 51.6 -71.9 -36.1 5.5 -50.4 -48.4 76 126 A K H X S+ 0 0 103 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.885 110.1 51.0 -65.0 -38.1 6.5 -48.7 -45.1 77 127 A W H X S+ 0 0 3 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.888 109.3 51.3 -64.8 -39.9 9.9 -48.2 -46.7 78 128 A Y H X S+ 0 0 29 -4,-1.8 4,-1.9 1,-0.2 3,-0.3 0.943 109.0 49.4 -61.6 -50.4 8.2 -46.7 -49.7 79 129 A N H X S+ 0 0 68 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.873 107.6 54.6 -58.3 -40.2 6.2 -44.3 -47.6 80 130 A L H X S+ 0 0 19 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.863 106.0 53.2 -63.2 -34.6 9.3 -43.2 -45.8 81 131 A M H < S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.907 110.2 46.9 -66.4 -41.8 10.9 -42.3 -49.1 82 132 A I H >< S+ 0 0 47 -4,-1.9 3,-1.8 1,-0.2 4,-0.3 0.931 108.9 53.7 -66.0 -45.2 8.0 -40.2 -50.1 83 133 A Q H 3< S+ 0 0 145 -4,-2.6 -1,-0.2 1,-0.3 3,-0.2 0.825 118.8 36.4 -57.2 -34.6 7.8 -38.3 -46.7 84 134 A N T 3X S+ 0 0 30 -4,-1.5 4,-2.6 -5,-0.2 -1,-0.3 0.063 81.3 121.3-106.0 21.7 11.6 -37.5 -47.2 85 135 A K H <> + 0 0 72 -3,-1.8 4,-2.1 1,-0.2 5,-0.2 0.840 69.5 54.6 -57.4 -38.5 11.6 -36.9 -51.0 86 136 A D H > S+ 0 0 85 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.941 114.3 39.8 -62.9 -46.9 12.8 -33.3 -50.9 87 137 A D H > S+ 0 0 45 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.932 113.6 54.7 -66.9 -45.7 15.9 -34.1 -48.9 88 138 A L H X S+ 0 0 7 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.848 110.4 47.6 -56.0 -34.8 16.5 -37.4 -50.7 89 139 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 5,-0.3 0.871 106.4 55.3 -75.5 -37.9 16.5 -35.4 -54.0 90 140 A R H X S+ 0 0 83 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.918 107.2 52.8 -60.4 -39.1 18.8 -32.7 -52.6 91 141 A I H X S+ 0 0 4 -4,-2.4 4,-1.8 2,-0.2 5,-0.3 0.901 108.1 49.4 -63.0 -40.9 21.2 -35.6 -51.9 92 142 A I H X>S+ 0 0 0 -4,-1.4 4,-3.2 1,-0.2 5,-0.7 0.949 114.3 44.2 -63.7 -47.5 21.0 -36.9 -55.5 93 143 A T H X5S+ 0 0 1 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.846 110.9 57.0 -64.5 -34.4 21.7 -33.5 -57.0 94 144 A A H <5S+ 0 0 16 -4,-2.5 -62,-0.2 -5,-0.3 -1,-0.2 0.871 121.1 24.7 -66.9 -37.1 24.4 -32.9 -54.5 95 145 A E H <5S+ 0 0 1 -4,-1.8 -2,-0.2 -65,-0.2 -3,-0.2 0.781 131.2 36.2-100.2 -30.0 26.4 -36.0 -55.5 96 146 A S H <5S- 0 0 1 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.1 0.740 92.3-137.4 -92.8 -26.8 25.3 -36.7 -59.1 97 147 A G << + 0 0 1 -4,-0.9 226,-0.3 -5,-0.7 -4,-0.2 0.349 51.9 144.0 87.5 -7.2 25.1 -33.1 -60.1 98 148 A K - 0 0 2 -6,-0.4 -1,-0.3 233,-0.1 5,-0.1 -0.361 62.8 -81.4 -67.1 144.1 21.8 -33.6 -62.0 99 149 A P > - 0 0 4 0, 0.0 4,-2.1 0, 0.0 3,-0.4 -0.063 37.9-114.7 -46.9 140.7 19.2 -30.8 -61.8 100 150 A L H > S+ 0 0 45 223,-2.1 4,-2.2 1,-0.3 5,-0.2 0.836 117.6 54.1 -46.4 -38.8 17.1 -30.7 -58.8 101 151 A K H > S+ 0 0 181 222,-0.3 4,-1.8 227,-0.3 -1,-0.3 0.951 107.8 48.1 -64.9 -47.8 14.0 -31.4 -60.9 102 152 A E H > S+ 0 0 46 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.801 110.4 53.5 -62.4 -28.3 15.6 -34.5 -62.4 103 153 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.893 105.8 52.1 -72.8 -39.3 16.5 -35.6 -58.9 104 154 A H H X S+ 0 0 58 -4,-2.2 4,-1.5 -5,-0.2 -2,-0.2 0.848 108.0 53.7 -62.3 -34.2 12.9 -35.2 -57.8 105 155 A G H X S+ 0 0 42 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.898 108.8 47.7 -67.8 -41.0 12.0 -37.4 -60.8 106 156 A E H X S+ 0 0 6 -4,-1.7 4,-4.4 1,-0.2 5,-0.3 0.939 107.0 55.3 -66.7 -46.4 14.4 -40.1 -59.6 107 157 A I H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.878 111.1 45.0 -55.4 -39.8 13.2 -40.1 -56.0 108 158 A L H X S+ 0 0 70 -4,-1.5 4,-3.4 2,-0.2 -1,-0.2 0.964 116.2 45.9 -66.3 -50.5 9.7 -40.8 -57.1 109 159 A Y H X S+ 0 0 31 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.924 114.1 49.1 -55.8 -48.3 10.8 -43.4 -59.6 110 160 A S H X S+ 0 0 0 -4,-4.4 4,-1.2 1,-0.2 3,-0.5 0.917 113.2 46.8 -58.9 -45.2 13.1 -44.9 -56.9 111 161 A A H >X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.3 3,-0.5 0.933 105.9 59.3 -63.2 -45.5 10.2 -44.9 -54.4 112 162 A F H 3X S+ 0 0 73 -4,-3.4 4,-3.1 1,-0.3 -1,-0.2 0.753 99.5 58.3 -56.1 -27.2 7.8 -46.4 -57.0 113 163 A F H 3X S+ 0 0 4 -4,-1.2 4,-2.6 -3,-0.5 5,-0.3 0.924 107.4 45.1 -70.3 -43.5 10.1 -49.5 -57.3 114 164 A L H < S+ 0 0 24 -4,-0.8 3,-2.6 1,-0.2 -2,-0.2 0.832 88.3 76.1 -77.0 -34.1 4.7 -58.4 -56.1 121 171 A A G >< S+ 0 0 2 -4,-2.1 3,-0.7 1,-0.3 -1,-0.2 0.825 96.6 46.5 -46.7 -41.6 5.7 -60.1 -52.9 122 172 A R G 3 S+ 0 0 124 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.495 105.5 65.0 -83.1 -1.9 2.2 -61.6 -52.3 123 173 A R G < + 0 0 132 -3,-2.6 2,-1.0 -4,-0.1 -1,-0.2 0.026 58.2 124.4-112.1 29.0 1.9 -62.7 -55.9 124 174 A V < - 0 0 46 -3,-0.7 2,-0.4 18,-0.1 18,-0.1 -0.781 46.1-167.3 -86.9 107.7 4.6 -65.3 -56.3 125 175 A Y - 0 0 148 -2,-1.0 2,-0.1 16,-0.1 -2,-0.1 -0.824 14.5-154.9-107.4 138.0 2.6 -68.3 -57.5 126 176 A G - 0 0 42 -2,-0.4 2,-0.3 16,-0.1 15,-0.2 -0.359 23.0-120.2 -91.5 178.4 3.6 -72.0 -57.9 127 177 A D E -I 140 0C 82 13,-1.7 13,-3.0 -2,-0.1 2,-0.5 -0.848 9.0-149.9-124.8 161.2 2.0 -74.4 -60.3 128 178 A I E -I 139 0C 142 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.996 27.1-167.4-126.7 117.3 0.0 -77.6 -60.3 129 179 A I E -I 138 0C 85 9,-2.4 9,-1.2 -2,-0.5 2,-0.4 -0.875 17.4-129.8-113.7 141.0 0.7 -79.6 -63.5 130 180 A H - 0 0 170 -2,-0.4 7,-0.1 7,-0.1 3,-0.1 -0.741 27.8-179.9 -90.6 134.9 -1.1 -82.7 -64.9 131 181 A T - 0 0 34 -2,-0.4 5,-0.1 5,-0.3 7,-0.0 -0.853 38.6-110.6-124.8 162.3 1.0 -85.6 -65.9 132 182 A P S S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.958 89.6 94.0 -59.0 -53.1 -0.1 -89.0 -67.3 133 183 A A > - 0 0 33 1,-0.2 3,-0.7 2,-0.1 -2,-0.3 -0.125 62.0-157.4 -44.4 125.8 0.8 -91.1 -64.2 134 184 A K T 3 S+ 0 0 190 1,-0.2 -1,-0.2 351,-0.1 3,-0.0 0.550 86.0 65.1 -85.8 -7.8 -2.4 -91.5 -62.1 135 185 A D T 3 S+ 0 0 61 349,-0.0 350,-2.2 2,-0.0 2,-0.3 0.197 101.9 50.5 -99.8 14.7 -0.4 -92.2 -58.9 136 186 A R < - 0 0 99 -3,-0.7 2,-0.4 347,-0.2 -5,-0.3 -0.994 57.9-152.2-153.1 158.2 1.3 -88.8 -58.7 137 187 A R E - J 0 482C 125 345,-2.6 345,-2.3 -2,-0.3 2,-0.5 -0.963 18.5-136.5-129.7 145.3 0.8 -85.0 -58.8 138 188 A A E +IJ 129 481C 3 -9,-1.2 -9,-2.4 -2,-0.4 2,-0.4 -0.911 22.5 178.6-108.9 122.9 3.2 -82.3 -59.9 139 189 A L E -IJ 128 480C 50 341,-2.6 341,-3.5 -2,-0.5 2,-0.5 -0.924 12.7-157.2-118.7 144.7 3.6 -79.2 -57.9 140 190 A V E -IJ 127 479C 15 -13,-3.0 -13,-1.7 -2,-0.4 2,-0.3 -0.961 10.9-170.3-127.1 116.0 6.0 -76.3 -58.6 141 191 A L E - J 0 478C 74 337,-2.5 337,-2.4 -2,-0.5 2,-0.5 -0.697 12.9-145.8 -99.8 155.4 7.1 -74.0 -55.8 142 192 A K E + J 0 477C 70 -2,-0.3 335,-0.2 335,-0.2 -16,-0.1 -0.992 23.8 175.6-121.8 125.8 9.1 -70.8 -56.2 143 193 A Q E - J 0 476C 78 333,-2.2 333,-2.5 -2,-0.5 29,-0.1 -0.964 35.4 -92.7-132.3 150.1 11.5 -70.0 -53.5 144 194 A P E - J 0 475C 33 0, 0.0 331,-0.2 0, 0.0 3,-0.1 -0.262 27.6-131.4 -61.5 143.9 14.1 -67.1 -53.0 145 195 A I - 0 0 22 329,-1.9 2,-0.4 1,-0.2 330,-0.1 0.854 43.9-120.9 -64.2 -39.5 17.7 -67.7 -54.2 146 196 A G + 0 0 3 328,-0.3 28,-1.3 28,-0.1 2,-0.4 -0.987 68.0 11.2 137.1-125.7 19.4 -66.5 -51.0 147 197 A V E -c 174 0A 1 79,-0.5 81,-2.3 -2,-0.4 82,-1.6 -0.774 63.2-160.2 -95.5 134.8 21.8 -63.7 -50.6 148 198 A A E -cd 175 229A 0 26,-2.1 28,-2.0 -2,-0.4 2,-0.6 -0.925 12.7-141.2-118.2 137.7 22.4 -61.3 -53.5 149 199 A A E -cd 176 230A 0 80,-3.0 82,-2.9 -2,-0.4 2,-0.5 -0.849 21.9-163.0 -95.0 123.7 25.3 -59.0 -54.2 150 200 A V E +cd 177 231A 0 26,-2.6 28,-2.8 -2,-0.6 2,-0.5 -0.950 11.0 179.9-115.4 123.0 24.1 -55.7 -55.6 151 201 A I E -cd 178 232A 13 80,-2.5 82,-1.7 -2,-0.5 26,-0.1 -0.973 10.8-176.9-125.3 116.4 26.5 -53.3 -57.4 152 202 A T - 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